(4-methyl-2-oxidanylidene-6-phenyl-3-prop-2-enyl-pyridin-1-yl) benzenesulfonate

Systemtic Name: (4-methyl-2-oxidanylidene-6-phenyl-3-prop-2-enyl-pyridin-1-yl) benzenesulfonate Openeye Name: (3-allyl-4-methyl-2-oxo-6-phenyl-1-pyridyl) benzenesulfonate CAS Name: benzenesulfonic acid (4-methyl-2-oxo-6-phenyl-3-prop-2-enyl-1-pyridinyl) ester IUPAC Name: (4-methyl-2-oxo-6-phenyl-3-prop-2-enylpyridin-1-yl) benzenesulfonate Traditional Name: benzenesulfonic acid (3-allyl-2-keto-4-methyl-6-phenyl-1-pyridyl) ester Formula: C21H19NO4S MolecularWeight: 381.44486

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(C(=C1)C2=CC=CC=C2)OS(=O)(=O)C3=CC=CC=C3)CC=C

Isomeric SMILES

CC1=C(C(=O)N(C(=C1)C2=CC=CC=C2)OS(=O)(=O)C3=CC=CC=C3)CC=C

InChI

InChI=1S/C21H19NO4S/c1-3-10-19-16(2)15-20(17-11-6-4-7-12-17)22(21(19)23)26-27(24,25)18-13-8-5-9-14-18/h3-9,11-15H,1,10H2,2H3